Quantum Chemistry of Solids : LCAO Treatment of Crystals and Nanostructures - gebunden oder broschiert
2013, ISBN: 3642303552
[EAN: 9783642303555], Neubuch, [SC: 0.0], [PU: Springer Berlin Heidelberg], FESTKÖRPERPHYSIK; HARTREE-FOCK(KOHN-SHAM)LCAOCALCULATIONS; DIELECTRICCONSTANTSOFCRYSTALS; FIRSTPRINCIPLESLCAOCA… Mehr…
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2018, ISBN: 9783642303555
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Quantum Chemistry of Solids : LCAO Treatment of Crystals and Nanostructures - gebunden oder broschiert
2013, ISBN: 3642303552
[EAN: 9783642303555], Neubuch, [SC: 0.0], [PU: Springer Berlin Heidelberg], FESTKÖRPERPHYSIK; HARTREE-FOCK(KOHN-SHAM)LCAOCALCULATIONS; DIELECTRICCONSTANTSOFCRYSTALS; FIRSTPRINCIPLESLCAOCA… Mehr…
2018, ISBN: 9783642303555
[ED: Buch], [PU: Springer Berlin Heidelberg], Neuware - Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first p… Mehr…
ISBN: 9783642303555
Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of period… Mehr…
ISBN: 9783642303555
Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of period… Mehr…
ISBN: 9783642303555
Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of period… Mehr…
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The second part deals with the applications of LCAO methods for calculations of bulk crystal properties, including magnetic ordering and crystal structure optimization. In the second edition two new chapters are added in the application part II of the book.
Chapter 12 deals with the recent LCAO calculations and illustrates the efficiency of the scalar-relativistic LCAO method for solids, containing heavy atoms. Chapter 13 deals with the symmetry properties and the recent applications of LCAO method to inorganic nanotubes.
New material is added to chapter 9 devoted to LCAO calculations of perfect-crystal properties. The possibilities of LCAO method for calculation of the high-frequency dielectric constants of crystals and the description of phase transitions in solids are discussed. The efficiency of LCAO method in the quantum-mechanics-molecular dynamics approach to the interpretation of x-ray absorption and EXAFS spectra is illustrated. A new section is devoted to recent LCAO calculations of electronic, vibrational and magnetic properties of tungstates MeWO4 (Me: Fe,Co,Ni,Cu,Zn,Cd).
Detailangaben zum Buch - Quantum Chemistry of Solids: LCAO Treatment of Crystals and Nanostructures Robert A. Evarestov Author
EAN (ISBN-13): 9783642303555
ISBN (ISBN-10): 3642303552
Gebundene Ausgabe
Erscheinungsjahr: 2013
Herausgeber: Springer Berlin Heidelberg Core >2
734 Seiten
Gewicht: 1,231 kg
Sprache: Englisch
Buch in der Datenbank seit 2009-02-17T08:44:20+01:00 (Zurich)
Detailseite zuletzt geändert am 2024-01-30T14:30:35+01:00 (Zurich)
ISBN/EAN: 9783642303555
ISBN - alternative Schreibweisen:
3-642-30355-2, 978-3-642-30355-5
Alternative Schreibweisen und verwandte Suchbegriffe:
Autor des Buches: eva, robert, molecular electronic structure theory
Titel des Buches: chemistry sciences, quant, quan, quantum, springer series solid state sciences, 153
Daten vom Verlag:
Autor/in: Robert A. Evarestov
Titel: Springer Series in Solid-State Sciences; Quantum Chemistry of Solids - LCAO Treatment of Crystals and Nanostructures
Verlag: Springer; Springer Berlin
734 Seiten
Erscheinungsjahr: 2013-01-18
Berlin; Heidelberg; DE
Gedruckt / Hergestellt in Niederlande.
Gewicht: 1,286 kg
Sprache: Englisch
213,99 € (DE)
219,99 € (AT)
236,00 CHF (CH)
POD
XVIII, 734 p.
BB; Solid State Physics; Hardcover, Softcover / Physik, Astronomie/Atomphysik, Kernphysik; Physik der kondensierten Materie (Flüssigkeits- und Festkörperphysik); Verstehen; Physik; Hartree-Fock (Kohn-Sham) LCAO calculations; dielectric constants of crystals; first principles LCAO calculations for solids; inorganic nanotubes computer modeling; point defects in crystals computer modeling; surface of solids computer modeling; symmetry of crystalline structures; Nanoscale Science and Technology; Physical Chemistry; Crystallography and Scattering Methods; Condensed Matter Physics; Nanophysics; Physical Chemistry; Crystallography and Scattering Methods; Nanowissenschaften; Physikalische Chemie; Werkstoffprüfung; BB; BC; EA; BA
New material is added to chapter 9 devoted to LCAO calculations of perfect-crystal properties. The possibilities of LCAO method for calculation of the high-frequency dielectric constants of crystals and the description of phase transitions in solids are discussed. The efficiency of LCAO method in the quantum-mechanics-molecular dynamics approach to the interpretation of x-ray absorption and EXAFS spectra is illustrated. A new section is devoted to recent LCAO calculations of electronic, vibrational and magnetic properties of tungstates MeWO4 (Me: Fe,Co,Ni,Cu,Zn,Cd).Weitere, andere Bücher, die diesem Buch sehr ähnlich sein könnten:
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9783642430411 Quantum Chemistry Of Solids by Robert A. Evarestov Paperback | Indigo Chapters (Robert A. Evarestov)
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